phenyl(pyridin-2-yl)methanesulfonamide

C12H12N2O2S — CID 62085635

IUPACphenyl(pyridin-2-yl)methanesulfonamide
SMILESNS(=O)(=O)C(c1ccccc1)c1ccccn1
InChIInChI=1S/C12H12N2O2S/c13-17(15,16)12(10-6-2-1-3-7-10)11-8-4-5-9-14-11/h1-9,12H,(H2,13,15,16)
InChIKeyKVSUVEIIWIKSED-UHFFFAOYSA-N
MW248.31 g/mol
LogP1.46
Rot. Bonds3

About phenyl(pyridin-2-yl)methanesulfonamide

phenyl(pyridin-2-yl)methanesulfonamide (PubChem CID 62085635) has the molecular formula C12H12N2O2S and a molecular weight of 248.31 g/mol. Its IUPAC name is phenyl(pyridin-2-yl)methanesulfonamide.

Molecular Properties

Compound Namephenyl(pyridin-2-yl)methanesulfonamide
PubChem CID62085635
Molecular FormulaC12H12N2O2S
Molecular Weight248.31 g/mol
Exact Mass248.06
IUPAC Namephenyl(pyridin-2-yl)methanesulfonamide
SMILESNS(=O)(=O)C(c1ccccc1)c1ccccn1
InChIInChI=1S/C12H12N2O2S/c13-17(15,16)12(10-6-2-1-3-7-10)11-8-4-5-9-14-11/h1-9,12H,(H2,13,15,16)
InChIKeyKVSUVEIIWIKSED-UHFFFAOYSA-N
XLogP1.46
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(S)-phenyl-(sulfamoylamino)methyl]pyridine
CID 95133440
(1R)-1-pyridin-2-ylethanesulfonamide
CID 94347246
dipyridin-2-ylmethanesulfonic acid
CID 11569476
2-[phenyl(pyridin-2-yl)methyl]pyridine
CID 4110137
4-hydroxy-4-pyridin-2-ylbutane-2-sulfonamide
CID 140565025
N-(2-phenyl-2-pyridin-2-ylethyl)methanesulfonamide
CID 16929296
[(1S,2S)-1-phenyl-2-phosphanyl-2-pyridin-2-ylethyl]phosphane
CID 101016472
ethane;2-(1-phenylethyl)pyridine
CID 143899083
N-methyl-N-[methyl-[(S)-phenyl(pyridin-2-yl)methyl]sulfamoyl]propan-2-amine
CID 97194118
2-phenyl-2-pyridin-2-ylsulfonylacetonitrile
CID 25186357
CID 175476137
CID 175476137
3-phenyl-3-pyridin-2-ylpropanenitrile
CID 10465646

Frequently Asked Questions

What is the IUPAC name of phenyl(pyridin-2-yl)methanesulfonamide?
The IUPAC name of phenyl(pyridin-2-yl)methanesulfonamide (CID 62085635) is phenyl(pyridin-2-yl)methanesulfonamide.
What is the SMILES notation for phenyl(pyridin-2-yl)methanesulfonamide?
The canonical SMILES for phenyl(pyridin-2-yl)methanesulfonamide is NS(=O)(=O)C(c1ccccc1)c1ccccn1.
What is the InChIKey of phenyl(pyridin-2-yl)methanesulfonamide?
The InChIKey is KVSUVEIIWIKSED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2S/c13-17(15,16)12(10-6-2-1-3-7-10)11-8-4-5-9-14-11/h1-9,12H,(H2,13,15,16).
What are the key properties of phenyl(pyridin-2-yl)methanesulfonamide?
phenyl(pyridin-2-yl)methanesulfonamide has a molecular weight of 248.31 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl(pyridin-2-yl)methanesulfonamide is sourced from PubChem (CID 62085635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).